Jurnal Kartika Kimia
Vol 8 No 2 (2025): Jurnal Kartika Kimia (In Progress)

Prenylated Flavonoids from Artocarpus elasticus: Structural Characterization and Molecular Docking toward Acetylcholinesterase

Musthapa, Iqbal (Unknown)
Sebastian, Yolanda (Unknown)
nuraini, Vidia afina (Unknown)



Article Info

Publish Date
19 Mar 2026

Abstract

Prenylated flavonoids from Artocarpus spp. are a rich source of bioactive natural products, and several members have been reported to inhibit acetylcholinesterase (AChE), a therapeutic target for symptomatic management of cognitive impairment. However, reports focusing on AChE-related studies of prenylated flavonoids from Indonesian Artocarpus elasticus bark remain scarce. In this study, the ethyl acetate extract of A. elasticus stem bark collected in West Java, Indonesia, was fractionated by chromatographic techniques to afford two prenylated flavonoids. Compound 1 was tentatively assigned as artobiloxanthone based mainly on 1H NMR comparison with literature data, whereas compound 2 was identified as cudraflavone C supported by UV, FTIR, 1H NMR, and HR-ESIMS. A validated molecular docking protocol (re-docking RMSD 0.37 Å) using human AChE (PDB 4EY7) indicated low predicted binding energies for 1 and 2 (–4.1 and –3.9 kcal/mol) relative to donepezil (–12.0 kcal/mol). Both ligands mainly interacted with peripheral/mid-gorge residues and did not engage the catalytic triad, suggesting limited AChE inhibition potential in silico. These findings provide chemotaxonomic information on Indonesian A. elasticus bark and highlight the need for complementary in vitro AChE assays to confirm bioactivity.

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Journal Info

Abbrev

jkk

Publisher

Subject

Biochemistry, Genetics & Molecular Biology Chemical Engineering, Chemistry & Bioengineering Chemistry Education

Description

Jurnal Kartika Kimia is National Journal that publish all research article/ review/ short communication related to progres of chemistry researchs. Scope of this journal are: 1) Analytical Chemistry ; 2) Inorganic Chemistry ; 3) Physical Chemistry ; 4) Organic Chemistry ; 5) Biochemistry also ...